BioCAD format, all rights reserved
Generated coords from CombiChem; Version 12.00-1
NAME compound 1
PROP 7 1
18 18
1 C    0  0.0000 -50.0 -94.0 86.0   3   6   2  11  U
2 C    0  0.0000 -188.0 -74.0 82.0   3   1   3  12  U
3 C    0  0.0000 -244.0 36.0 14.0   3   2   4  13  U
4 C    0  0.0000 -158.0 128.0 -50.0   3   3   5  14  U
5 C    0  0.0000 -18.0 108.0 -46.0   3   4   6  15  U
6 C    0  0.0000 38.0 -2.0 22.0   3   5   1   7  U
7 C    0  0.0000 186.0 -20.0 26.0   4   6   8  16  17  U
8 C    0  0.0000 260.0 106.0 22.0   3   7   9  10  U
9 O    0  0.0000 242.0 190.0 108.0   1   8  U
10 O    0  0.0000 338.0 126.0 -68.0   2   8  18  U
11 H    0  0.0000 -12.0 -174.0 136.0   1   1  U
12 H    0  0.0000 -250.0 -142.0 130.0   1   2  U
13 H    0  0.0000 -344.0 50.0 12.0   1   3  U
14 H    0  0.0000 -198.0 208.0 -100.0   1   4  U
15 H    0  0.0000 42.0 176.0 -92.0   1   5  U
16 H    0  0.0000 210.0 -78.0 118.0   1   7  U
17 H    0  0.0000 222.0 -84.0 -56.0   1   7  U
18 H    0  0.0000 388.0 212.0 -72.0   1  10  U
1 1.500     1   6   0 0
2 1.500     2   1   0 0
3 1.500     3   2   0 0
4 1.500     4   3   0 0
5 1.500     5   4   0 0
6 1.500     6   5   0 0
7 1.000     7   6   0 0
8 1.000     8   7   0 0
9 2.000     9   8   0 0
10 1.000    10   8   0 0
11 1.000     1  11   0 0
12 1.000     2  12   0 0
13 1.000     3  13   0 0
14 1.000     4  14   0 0
15 1.000     5  15   0 0
16 1.000     7  16   0 0
17 1.000     7  17   0 0
18 1.000    10  18   0 0
CONFS 9
NAME conf5
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 260.0 106.0 22.0
 242.0 190.0 108.0
 338.0 126.0 -68.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 210.0 -78.0 118.0
 222.0 -84.0 -56.0
 388.0 212.0 -72.0

NAME conf9
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 260.0 106.0 22.0
 338.0 126.0 -68.0
 244.0 190.0 108.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 210.0 -78.0 118.0
 222.0 -84.0 -56.0
 296.0 276.0 104.0

NAME conf6
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 232.0 -88.0 148.0
 290.0 -194.0 140.0
 210.0 -40.0 258.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 216.0 -76.0 -62.0
 240.0 74.0 20.0
 240.0 -88.0 340.0

NAME conf3
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 232.0 -88.0 148.0
 210.0 -40.0 258.0
 290.0 -194.0 140.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 216.0 -76.0 -62.0
 240.0 74.0 20.0
 320.0 -242.0 224.0

NAME conf4
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 256.0 90.0 90.0
 322.0 74.0 190.0
 246.0 204.0 44.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 206.0 -116.0 80.0
 228.0 -34.0 -74.0
 292.0 280.0 90.0

NAME conf2
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 240.0 -22.0 162.0
 202.0 -104.0 244.0
 322.0 62.0 196.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 210.0 -114.0 -24.0
 238.0 58.0 -30.0
 356.0 62.0 290.0

NAME conf7
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 240.0 -22.0 162.0
 322.0 60.0 196.0
 202.0 -104.0 244.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 210.0 -114.0 -24.0
 238.0 58.0 -30.0
 238.0 -102.0 338.0

NAME conf8
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 248.0 44.0 142.0
 240.0 164.0 156.0
 310.0 -20.0 224.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 206.0 -128.0 28.0
 234.0 18.0 -64.0
 354.0 26.0 302.0

NAME conf1
 -50.0 -94.0 86.0
 -188.0 -74.0 82.0
 -244.0 36.0 14.0
 -158.0 128.0 -50.0
 -18.0 108.0 -46.0
 38.0 -2.0 22.0
 186.0 -20.0 26.0
 240.0 -22.0 162.0
 298.0 -118.0 206.0
 226.0 76.0 234.0
 -12.0 -174.0 136.0
 -250.0 -142.0 130.0
 -344.0 50.0 12.0
 -198.0 208.0 -100.0
 42.0 176.0 -92.0
 210.0 -114.0 -24.0
 238.0 58.0 -30.0
 262.0 76.0 328.0

